Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.43 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Water SCHEMBL8488269 | 0.82 | L3MBTL1 (0.57) | ALDH1A1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL8493177 | 0.81 | CA12 (0.42) | ALDH1A1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL8578033 | 0.80 | CA12 (0.57) | ALDH1A1TAAR1CA12CA1CA2 | |
| SCHEMBL8492228 | 0.78 | ALDH1A1 (0.50) | ALDH1A1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL8490185 | 0.76 | L3MBTL1 (0.48) | ALDH1A1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7952165 | 0.75 | CA12 (0.42) | ALDH1A1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7956978 | 0.74 | ALDH1A1 (0.51) | ALDH1A1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7954653 | 0.74 | CA12 (0.46) | ALDH1A1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7944017 | 0.73 | CA12 (0.40) | ALDH1A1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL717082 | 0.72 | CA1 (0.45) | ALDH1A1LMNACYP1A2CYP3A4CYP2D6 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1999032467-A1 | 1,2,4-BENZOTHIADIAZINE DERIVATIVES, THEIR PREPARATION AND USE | NOVO NORDISK A/S (DK) | 1999-07-01 | — | — | WO | disclosed |